[3-azanyl-5-(tert-butylamino)-4-piperazin-1-ylcarbonyl-thiophen-2-yl]-(2,4-dichlorophenyl)methanone

Systemtic Name: [3-azanyl-5-(tert-butylamino)-4-piperazin-1-ylcarbonyl-thiophen-2-yl]-(2,4-dichlorophenyl)methanone Openeye Name: [3-amino-5-(tert-butylamino)-4-(piperazine-1-carbonyl)-2-thienyl]-(2,4-dichlorophenyl)methanone CAS Name: [3-amino-5-(tert-butylamino)-4-[oxo(1-piperazinyl)methyl]-2-thiophenyl]-(2,4-dichlorophenyl)methanone IUPAC Name: [3-amino-5-(tert-butylamino)-4-(piperazine-1-carbonyl)thiophen-2-yl]-(2,4-dichlorophenyl)methanone Traditional Name: [3-amino-5-(tert-butylamino)-4-(piperazine-1-carbonyl)-2-thienyl]-(2,4-dichlorophenyl)methanone Formula: C20H24Cl2N4O2S MolecularWeight: 455.40116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=C(C(=C(S1)C(=O)C2=C(C=C(C=C2)Cl)Cl)N)C(=O)N3CCNCC3

Isomeric SMILES

CC(C)(C)NC1=C(C(=C(S1)C(=O)C2=C(C=C(C=C2)Cl)Cl)N)C(=O)N3CCNCC3

InChI

InChI=1S/C20H24Cl2N4O2S/c1-20(2,3)25-18-14(19(28)26-8-6-24-7-9-26)15(23)17(29-18)16(27)12-5-4-11(21)10-13(12)22/h4-5,10,24-25H,6-9,23H2,1-3H3